2-[[4-ethyl-5-[(9-oxidanylideneacridin-10-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[4-ethyl-5-[(9-oxidanylideneacridin-10-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[4-ethyl-5-[(9-oxoacridin-10-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetonitrile CAS Name: 2-[[4-ethyl-5-[(9-oxo-10-acridinyl)methyl]-1,2,4-triazol-3-yl]thio]acetonitrile IUPAC Name: 2-[[4-ethyl-5-[(9-oxoacridin-10-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetonitrile Traditional Name: 2-[[4-ethyl-5-[(9-ketoacridin-10-yl)methyl]-1,2,4-triazol-3-yl]thio]acetonitrile Formula: C20H17N5OS MolecularWeight: 375.44688

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC#N)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

Isomeric SMILES

CCN1C(=NN=C1SCC#N)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

InChI

InChI=1S/C20H17N5OS/c1-2-24-18(22-23-20(24)27-12-11-21)13-25-16-9-5-3-7-14(16)19(26)15-8-4-6-10-17(15)25/h3-10H,2,12-13H2,1H3